CID 21149776

Ns00063501

Structural Information

Molecular Formula
C14H30N2O2
SMILES
CCCCCCC(C)(C)C(=O)NCCNCCO
InChI
InChI=1S/C14H30N2O2/c1-4-5-6-7-8-14(2,3)13(18)16-10-9-15-11-12-17/h15,17H,4-12H2,1-3H3,(H,16,18)
InChIKey
JCGDBXIOQPBKGH-UHFFFAOYSA-N
Compound name
N-[2-(2-hydroxyethylamino)ethyl]-2,2-dimethyloctanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.23074 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.238016 168.4
[M+Na]+ 281.219958 170.6
[M-H]- 257.223464 166.0
[M+NH4]+ 276.264563 184.1
[M+K]+ 297.193898 168.6
[M+H-H2O]+ 241.228000 162.2
[M+HCOO]- 303.228941 188.2
[M+CH3COO]- 317.244591 202.1
[M+Na-2H]- 279.205406 170.7
[M]+ 258.23019142 170.1
[M]- 258.23128858 170.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.